SCHEMBL949470

SCHEMBL949470

O=C1CC(CCCCCCN2C(=O)C=CC2=O)C(=O)N1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.50
FAAH O00519 5/20 0.50
ALDH1A1 P00352 3/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 2/20 0.50
RECQL P46063 2/20 0.50
HSP90AA1 P07900 1/20 0.50
TLR9 Q9NR96 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
PKM P14618 1/20 0.50
XBP1 P17861 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GPR35 Q9HC97 1/20 0.50
GPR55 Q9Y2T6 1/20 0.50
PTGS1 P23219 7/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL129229 0.77 PTGS1 (0.53) MGLLFAAHALDH1A1RAB9AHPGD
SCHEMBL9181452 0.76 CYP1A2 (0.40) ALDH1A1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL7128299 0.76 SIGMAR1 (0.32)
SCHEMBL1758179 0.74 CYP1A2 (0.38) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL7626957 0.74 LMNA (0.39) LMNAPKMMAPK1PTGS1PTGS2
SCHEMBL1324992 0.73
SCHEMBL1324959 0.73
SCHEMBL25215380 0.73 ACE (0.34)
SCHEMBL13003189 0.73 ELANE (0.37) ALDH1A1RAB9AHPGDLMNATP53
SCHEMBL603323 0.72 PTGS1 (0.47) MGLLFAAHALDH1A1RAB9AHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110020239-A1 METHODS FOR IN VIVO IMAGING OF CELLS THE JOHNS HOPKINS UNIVERSITY (US) 2011-01-27 US disclosed
EP-2155065-A1 METHODS FOR IN VIVO IMAGING OF CELLS The Johns Hopkins University (US) 2010-02-24 EP disclosed
US-7517700-B2 Colloidal metal particles having a coatings comprising noncross-linked, SH-activated dextran and derivative, used as detection reagents in immunology bioassays ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2009-04-14 US disclosed
WO-2008144028-A1 METHODS FOR IN VIVO IMAGING OF CELLS THE JOHNS HOPKINS UNIVERSITY (US) 2008-11-27 WO disclosed
US-20080032421-A1 Colloidal metal particles having a coatings comprising noncross-linked, SH-activated dextran and derivative, used as detection reagents in immunology bioassays SLUKA PETER 2008-02-07 US disclosed
US-7256054-B2 Useful as detection reagents in immunoassays ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2007-08-14 US disclosed
US-20040038431-A1 Useful as detection reagents in immunoassays ROCHE DIAGNOSTICS OPERATIONS, INC. 2004-02-26 US disclosed